1-[3-(butanoylamino)-5-(dimethylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxylic acid

Systemtic Name: 1-[3-(butanoylamino)-5-(dimethylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxylic acid Openeye Name: 1-[3-(butanoylamino)-5-(dimethylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxylic acid CAS Name: 1-[5-[dimethylamino(oxo)methyl]-3-(1-oxobutylamino)-3-pyrrolyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-[3-(butanoylamino)-5-(dimethylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxylic acid Traditional Name: 1-[3-butyramido-5-(dimethylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxylic acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1(C=C(N=C1)C(=O)N(C)C)N2C=CC=C2C(=O)O

Isomeric SMILES

CCCC(=O)NC1(C=C(N=C1)C(=O)N(C)C)N2C=CC=C2C(=O)O

InChI

InChI=1S/C16H20N4O4/c1-4-6-13(21)18-16(20-8-5-7-12(20)15(23)24)9-11(17-10-16)14(22)19(2)3/h5,7-10H,4,6H2,1-3H3,(H,18,21)(H,23,24)